60193759 -OEChem-05042415582D 72 77 0 1 0 0 0 0 0999 V2000 6.3966 3.4983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 2.9983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 -0.1353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -1.4159 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 1.4983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 1.8031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 2.9983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5555 -0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9697 -0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1286 0.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 0.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 -2.4159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 1.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 1.9983 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1286 -2.9159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4503 0.1936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2331 -3.9104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0422 -2.5092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 0.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2113 -4.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7113 -3.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2626 2.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9946 1.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0430 -0.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1397 2.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 0.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 1.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -0.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 -0.0354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7267 1.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 1.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 1.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 3.4983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4587 2.9983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -0.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1171 -1.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -1.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4081 -0.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3406 -0.0843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7392 0.6060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6520 -2.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0505 -2.9985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 2.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 -2.2967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6131 -3.9104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1683 -4.5270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5437 -2.1447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7322 -1.9722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0197 -4.7080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7777 -4.3705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2129 -3.6167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1261 -2.7916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8732 2.8907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4746 3.5809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4128 -1.2560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7290 2.9462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9471 3.3429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5504 2.5610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4771 1.4130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4621 1.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2592 1.0234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7635 -1.4408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3966 4.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 0.8783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4348 -0.7920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 -1.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 -1.3017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9957 1.6883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5927 4.1183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9957 3.3083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 65 1 0 0 0 0 2 24 2 0 0 0 0 3 30 1 0 0 0 0 3 33 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 5 24 1 0 0 0 0 6 14 1 0 0 0 0 6 20 1 0 0 0 0 6 26 1 0 0 0 0 7 31 1 0 0 0 0 7 35 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 14 2 0 0 0 0 12 17 1 0 0 0 0 13 16 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 15 23 1 1 0 0 0 15 45 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 46 1 0 0 0 0 17 20 2 0 0 0 0 17 25 1 0 0 0 0 18 21 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 22 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 24 28 1 0 0 0 0 25 29 2 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 26 60 1 0 0 0 0 27 30 2 0 0 0 0 27 61 1 0 0 0 0 28 31 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 31 32 2 0 0 0 0 32 34 1 0 0 0 0 32 66 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 34 36 2 0 0 0 0 34 70 1 0 0 0 0 35 36 1 0 0 0 0 35 71 1 0 0 0 0 36 72 1 0 0 0 0 M END > 60193759 > 1 > 783 > 5 > 1 > 6 > AAADcfB7sAAAAAAAAAAAAAAAAABYAeIAAAA8WIAAAAAAAFgB/AAAHgAACAAADyzhngY+xvMMFgCoAzV3VACCiCAxIiAI2CE+bJgOdvrE9ZuUcChmxhnY6AeY2POPoAAAAgACAABAAAAEAAQAAAAAAAAAAA== > 1-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-(2-pyridyl)ethanone > 1-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-(2-pyridinyl)ethanone > 1-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methylspiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-pyridin-2-ylethanone > 1-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methylspiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-pyridin-2-ylethanone > 1-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]-2-yl]-2-pyridin-2-yl-ethanone > 1-[(1S)-1'-(cyclopentylmethyl)-7-methoxy-9-methyl-1-methylol-spiro[1,3-dihydro-beta-carboline-4,3'-azetidine]-2-yl]-2-(2-pyridyl)ethanone > InChI=1S/C29H36N4O3/c1-31-24-14-22(36-2)10-11-23(24)27-28(31)25(16-34)33(26(35)13-21-9-5-6-12-30-21)19-29(27)17-32(18-29)15-20-7-3-4-8-20/h5-6,9-12,14,20,25,34H,3-4,7-8,13,15-19H2,1-2H3/t25-/m1/s1 > ZNBGNJILENUUTB-RUZDIDTESA-N > 2.7 > 488.27874102 > C29H36N4O3 > 488.6 > CN1C2=C(C=CC(=C2)OC)C3=C1C(N(CC34CN(C4)CC5CCCC5)C(=O)CC6=CC=CC=N6)CO > CN1C2=C(C=CC(=C2)OC)C3=C1[C@H](N(CC34CN(C4)CC5CCCC5)C(=O)CC6=CC=CC=N6)CO > 70.8 > 488.27874102 > 0 > 36 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 12 14 8 12 17 8 15 23 5 17 20 8 17 25 8 20 27 8 25 29 8 27 30 8 29 30 8 31 32 8 32 34 8 34 36 8 35 36 8 6 14 8 6 20 8 7 31 8 7 35 8 $$$$